Benchmarking ensemble docking methods in D3R Grand Challenge 4

The discovery of new drugs is a time consuming and expensive process. Methods such as virtual screening, which can filter out ineffective compounds from drug libraries prior to expensive experimental study, have become popular research topics. As the computational drug discovery community has grown,...

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Detalles Bibliográficos
Autores principales: Gan, Jessie Low, Kumar, Dhruv, Chen, Cynthia, Taylor, Bryn C., Jagger, Benjamin R., Amaro, Rommie E., Lee, Christopher T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8907095/
https://www.ncbi.nlm.nih.gov/pubmed/35199221
http://dx.doi.org/10.1007/s10822-021-00433-2

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8907095/
https://www.ncbi.nlm.nih.gov/pubmed/35199221
http://dx.doi.org/10.1007/s10822-021-00433-2

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